CID 6365764

Einecs 278-610-3

Structural Information

Molecular Formula
C15H24O2
SMILES
CCCCCCCCCC/C=C\1/C=CC(=O)O1
InChI
InChI=1S/C15H24O2/c1-2-3-4-5-6-7-8-9-10-11-14-12-13-15(16)17-14/h11-13H,2-10H2,1H3/b14-11-
InChIKey
QIKKUOPGWZUABH-KAMYIIQDSA-N
Compound name
(5Z)-5-undecylidenefuran-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.17763 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.184906 159.7
[M+Na]+ 259.166848 165.1
[M-H]- 235.170354 162.7
[M+NH4]+ 254.211453 178.1
[M+K]+ 275.140788 162.7
[M+H-H2O]+ 219.174890 153.7
[M+HCOO]- 281.175831 181.4
[M+CH3COO]- 295.191481 192.6
[M+Na-2H]- 257.152296 161.7
[M]+ 236.17708142 163.4
[M]- 236.17817858 163.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.